VASP Installation Errors: mpif90: error libraries: libimf.so

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manoj_wijesingha
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VASP Installation Errors: mpif90: error libraries: libimf.so

#1 Post by manoj_wijesingha » Wed Sep 21, 2022 7:33 pm

Hello,
I am trying to install vasp.6.3.1 but it gives errors. I use RedHat 8 Linux with AMD 16-core processor for my programs. Here is the error link:
"mpif90: error while loading shared libraries: libimf.so: cannot open shared object file: No such file or directory"

I used the makefile.include.gnu to make .include file, gcc/11.2.0, openmpi/4.1.4-intel_20.2, aocl/2.2-4 and aocc/2.3.0 compiler libraries for installation.

Could you please help me figure out and install VASP for this OS.
Thank you

Manoj.

ferenc_karsai
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Re: VASP Installation Errors: mpif90: error libraries: libimf.so

#2 Post by ferenc_karsai » Mon Sep 26, 2022 6:48 am

Please try the aocc makefiles in the arch directory.

manoj_wijesingha
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Re: VASP Installation Errors: mpif90: error libraries: libimf.so

#3 Post by manoj_wijesingha » Mon Sep 26, 2022 3:03 pm

Hello,
Thank you for your response and appreciate it, I actually used aocc, aocl, openmpi/4.1.4-intel_20.2 and hdf5/1.12.2 library modules to create makefile.include and compile the VASP. But it gives an error by mpif90 : libimf.so: cannot open shared object file: No such file or directory.
Could you please help me to install VASP on this cluster.
Thank you.

Manoj.

ferenc_karsai
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Re: VASP Installation Errors: mpif90: error libraries: libimf.so

#4 Post by ferenc_karsai » Mon Oct 03, 2022 10:16 am

actually used aocc, aocl, openmpi/4.1.4-intel_20.2 and hdf5/1.12.2 library modules

So you mean you tested aocc and intel ifort separately?

Please post your makefile.include and the corresponding exact toolchains you used.

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